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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00546793

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4MZ4-METHYLIMIDAZOLEA1DTM0.8
4MZ4-METHYLIMIDAZOLEA,B1KEQ0.8
4MZ4-METHYLIMIDAZOLEA2FNN0.8
4MZ4-METHYLIMIDAZOLEA1MOO0.8
4MZ4-METHYLIMIDAZOLEA1G0E0.8
NVI1-VINYLIMIDAZOLEA,B2AFZ0.9
NVI1-VINYLIMIDAZOLEA1AEJ0.9
IMDIMIDAZOLEA,B,C3H870.87
IMDIMIDAZOLEA1SQM0.87
IMDIMIDAZOLEA,B3CC10.87
IMDIMIDAZOLEA1AES0.87
IMDIMIDAZOLEA,B2HBA0.87
IMDIMIDAZOLEA,B3FVB0.87
IMDIMIDAZOLEA,B,C,D2QLE0.87
IMDIMIDAZOLEA2OD50.87
IMDIMIDAZOLEA,B2R4J0.87
IMDIMIDAZOLEA,B,C3FY40.87
IMDIMIDAZOLEA,B,C,D1I120.87
IMDIMIDAZOLEA1RUW0.87
IMDIMIDAZOLEA,B3GFF0.87
IMDIMIDAZOLEA,B,C,D1OUW0.87
IMDIMIDAZOLEA1PEE0.87
IMDIMIDAZOLEA,B2DDF0.87
IMDIMIDAZOLEX2AT30.87
IMDIMIDAZOLEA,B1R8E0.87
IMDIMIDAZOLEB,C,E,F1NU90.87
IMDIMIDAZOLEA,B3ECG0.87
IMDIMIDAZOLEA,B2R4E0.87
IMDIMIDAZOLEA1QPI0.87
IMDIMIDAZOLEA,B1HX30.87
IMDIMIDAZOLEA,B,C,D2Z3T0.87
IMDIMIDAZOLEA1L5N0.87
IMDIMIDAZOLEA,B2E2E0.87
IMDIMIDAZOLEA,C,H3F0Y0.87
IMDIMIDAZOLEA,B3D850.87
IMDIMIDAZOLEA1OD80.87
IMDIMIDAZOLET1Y590.87
IMDIMIDAZOLEX3B7U0.87
IMDIMIDAZOLEA1T8K0.87
IMDIMIDAZOLEA3C1J0.87
IMDIMIDAZOLEA2H7Q0.87
IMDIMIDAZOLEA,B1K6Z0.87
IMDIMIDAZOLEA,B,C,D,E,F,G1PZN0.87
IMDIMIDAZOLEA3EER0.87
IMDIMIDAZOLEA1DSO0.87
IMDIMIDAZOLEL1MRD0.87
IMDIMIDAZOLEA,B3EC00.87
IMDIMIDAZOLEA,B2W8X0.87
IMDIMIDAZOLEA1MUN0.87
IMDIMIDAZOLEA,B3C8L0.87
IMDIMIDAZOLEA1YXS0.87
IMDIMIDAZOLEA2NPJ0.87
IMDIMIDAZOLEL1MRC0.87
IMDIMIDAZOLEA2R5R0.87
IMDIMIDAZOLEA1IRC0.87
IMDIMIDAZOLEA2OBL0.87
IMDIMIDAZOLEA,B,C,D3C4E0.87
IMDIMIDAZOLEA3CHR0.87
IMDIMIDAZOLEA,B2ZQN0.87
IMDIMIDAZOLEX1PM10.87
IMDIMIDAZOLEA1V0M0.87
IMDIMIDAZOLEA2NPK0.87
IMDIMIDAZOLEO2G8C0.87
IMDIMIDAZOLEA2WCR0.87
IMDIMIDAZOLEA1CXA0.87
IMDIMIDAZOLEA,B,D1I1D0.87
IMDIMIDAZOLEA3D700.87
IMDIMIDAZOLEA3B7T0.87
IMDIMIDAZOLEA1MBI0.87
IMDIMIDAZOLEA,B,C,D3FCS0.87
IMDIMIDAZOLEA,B,C,D2ZC00.87
IMDIMIDAZOLEA1RKY0.87
IMDIMIDAZOLEA1V2G0.87
IMDIMIDAZOLEA,B,C,D3E490.87
IMDIMIDAZOLEA,B,C,D3HX80.87
IMDIMIDAZOLEA3CGX0.87
IMDIMIDAZOLEL3B7R0.87
IMDIMIDAZOLEA,B,C3DKQ0.87
IMDIMIDAZOLEA2DKK0.87
IMDIMIDAZOLEA,B,C,D1YXU0.87
IMDIMIDAZOLEH,J,L,N1OAU0.87
IMDIMIDAZOLEA2HVF0.87
IMDIMIDAZOLEA,B2V080.87
IMDIMIDAZOLEB,C,D1N1I0.87
IMDIMIDAZOLEA2PSD0.87
IMDIMIDAZOLEA1SXU0.87
IMDIMIDAZOLEA,B,C,D2GPE0.87
IMDIMIDAZOLEA1W7C0.87
IMDIMIDAZOLEA1NOC0.87
IMDIMIDAZOLEA,B3BR00.87
IMDIMIDAZOLEA3C1H0.87
IMDIMIDAZOLEA,B2OWQ0.87
IMDIMIDAZOLEA1HS60.87
IMDIMIDAZOLEA,B2HRC0.87
IMDIMIDAZOLEA3CHQ0.87
IMDIMIDAZOLEA1YXX0.87
IMDIMIDAZOLEA,B,C,D2RD90.87
IMDIMIDAZOLEA2UGI0.87
IMDIMIDAZOLEL1MRE0.87
IMDIMIDAZOLEC,D,G,H1NU70.87
IMDIMIDAZOLEA,B3C2Q0.87
IMDIMIDAZOLEA,B,C,D2G5F0.87
IMDIMIDAZOLEA1UUX0.87
IMDIMIDAZOLEA,B2VD30.87
IMDIMIDAZOLEA1UUY0.87
IMDIMIDAZOLEA4MBA0.87
IMDIMIDAZOLEA3HMZ0.87
IMDIMIDAZOLEA,C1HEZ0.87
IMDIMIDAZOLEA2NQC0.87
IMDIMIDAZOLEA3AKY0.87
IMDIMIDAZOLEA2OPC0.87
IMDIMIDAZOLEA3CHS0.87
IMDIMIDAZOLEA1WEG0.87
IMDIMIDAZOLEA3E2T0.87
IMDIMIDAZOLEA,C3G5O0.87
IMDIMIDAZOLEA2VZ50.87
IMDIMIDAZOLEA1H190.87
IMDIMIDAZOLEA1W8K0.87
IMDIMIDAZOLEA1DP90.87
IMDIMIDAZOLEA3CHP0.87
IMDIMIDAZOLEA,B2E180.87
IMDIMIDAZOLEA2O3P0.87
IMDIMIDAZOLEA2OH30.87
IMDIMIDAZOLEA3DEE0.87
IMDIMIDAZOLEA1DSP0.87
IMDIMIDAZOLET1Y5B0.87
IMDIMIDAZOLEL1MRF0.87
IMDIMIDAZOLEA2NOS0.87
IMDIMIDAZOLEA2NUH0.87
IMDIMIDAZOLEA2NOP0.87
IMDIMIDAZOLEA2PSE0.87
IMDIMIDAZOLEA1NMI0.87
IMDIMIDAZOLEA1DSG0.87
IMDIMIDAZOLEA,B,C,D1VDD0.87
IMDIMIDAZOLEA,B,C,D3EJ80.87
IMDIMIDAZOLEA,B2I6O0.87
IMDIMIDAZOLEA,B2VNQ0.87
IMDIMIDAZOLEA,B2GO30.87
IMDIMIDAZOLEA3GGD0.87
IMDIMIDAZOLEA1IKJ0.87
IMDIMIDAZOLEA2A0I0.87
IMDIMIDAZOLEA,B,C,D2QD10.87
IMDIMIDAZOLEA,B2R460.87
IMDIMIDAZOLEA1AKY0.87
IMDIMIDAZOLEA2VYO0.87
IMDIMIDAZOLEA,B1U170.87
IMDIMIDAZOLEA2C4W0.87
IMDIMIDAZOLEX2F5T0.87
IMDIMIDAZOLEA1GW60.87
IMDIMIDAZOLEA,B2R450.87
IMDIMIDAZOLEA1JRL0.87
IMDIMIDAZOLEA3D710.87
IMDIMIDAZOLEA,B2QD20.87
IMDIMIDAZOLEA2NPC0.87
IMDIMIDAZOLEA,B2QCU0.87
IMDIMIDAZOLEA,B2QZC0.87
IMDIMIDAZOLEA1NOS0.87
IMDIMIDAZOLEA,B,C,D1WWJ0.87
IMDIMIDAZOLEA2VJ80.87
IMDIMIDAZOLEA1W810.87
IMDIMIDAZOLEA,B2AH80.87
IMDIMIDAZOLET1Y5U0.87
IMDIMIDAZOLEA,B,C,D,E,F,
G,H,I,J,K,L
3E6Q0.87
IMDIMIDAZOLEA,B1KAE0.87
IMDIMIDAZOLEA1YWV0.87
IMDIMIDAZOLEA,B3EBZ0.87
IMDIMIDAZOLEA2NPD0.87
IMDIMIDAZOLEA1V0N0.87
IMDIMIDAZOLEA,B3VHB0.87
IMDIMIDAZOLEA1YXV0.87
IMDIMIDAZOLEX2ASN0.87
IMDIMIDAZOLEA,B2D6C0.87
IMDIMIDAZOLEA,B1WKQ0.87
IMDIMIDAZOLEA,B,C,D1GZ50.87
IMDIMIDAZOLEA,B,C1Y5E0.87
IMDIMIDAZOLEA2O630.87
IMDIMIDAZOLEA1DSE0.87
IMDIMIDAZOLEA,B3BQZ0.87
IMDIMIDAZOLEA,B,C,D,E,F2OGJ0.87
IMDIMIDAZOLEA1CCG0.87
IMDIMIDAZOLEA1DS40.87
IMDIMIDAZOLEA1U7R0.87
IMDIMIDAZOLEA1FI90.87
IMDIMIDAZOLEA,B3HDJ0.87
IMDIMIDAZOLEA,B1F4U0.87
IMDIMIDAZOLEA,B1L9E0.87
IMDIMIDAZOLEA1MUY0.87
IMDIMIDAZOLEA1FI70.87
IMDIMIDAZOLEA,B,C,D,E,F,
G,H
1UGI0.87
IMDIMIDAZOLEA,B,C,D2FMY0.87
IMDIMIDAZOLEA2O650.87
IMDIMIDAZOLEA,B2ZEG0.87
IMDIMIDAZOLEA2O640.87
IMDIMIDAZOLEA,B2ZQO0.87
IMDIMIDAZOLET1Y5A0.87
IMDIMIDAZOLEA2ZBX0.87
1MZ1-METHYLIMIDAZOLEA1AET0.91
1MZ1-METHYLIMIDAZOLEA1LSX0.91
1MZ1-METHYLIMIDAZOLEA1DUO0.91
1MZ1-METHYLIMIDAZOLEA2H7R0.91
AHNN-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDEA,B2AFW0.73
BVG1H-IMIDAZOL-2-YLMETHANOLA2EUU0.77
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CMP0.92
DMI2,3-DIMETHYLIMIDAZOLIUM IONA1CCI0.92
2MZ2-METHYLIMIDAZOLEA1AEU0.88
2IH1,1'-HEXANE-1,6-DIYLBIS(1H-IMIDAZOLE)A,D,G,J,M,Q2IWE0.77
2EZ2-ETHYLIMIDAZOLEA1AEQ0.91
HSMHISTAMINEA,B1U180.77
HSMHISTAMINEA1AVN0.77
HSMHISTAMINEA,B1KAR0.77
HSMHISTAMINEA,B1NP10.77
HSMHISTAMINEA,B1JQD0.77
HSMHISTAMINEA,B2QEB0.77
HSMHISTAMINEA,B1QFV0.77
HSMHISTAMINEA1IKE0.77
HSMHISTAMINEA3BU10.77
HSMHISTAMINEA,B1QFT0.77